Information card for entry 2202351

Structure parameters

• Chemical name: Methyl 2(S)-(N-fluoren-9-ylmethoxycarbonylamino)-3-(2-pyridyl)propionate
• Formula: C24 H22 N2 O4
• Calculated formula: C24 H22 N2 O4
• SMILES: c1(ncccc1)C[C@@H](C(=O)OC)NC(=O)OCC1c2c(cccc2)c2c1cccc2
• Title of publication: Methyl 2(<i>S</i>)-(<i>N</i>-fluoren-9-ylmethoxycarbonylamino)-3-(2-pyridyl)propionate
• Authors of publication: Clegg, William; Horsburgh, Lynne
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 9
• Pages of publication: o1257 - o1258
• a: 5.524 ± 0.004 Å
• b: 14.988 ± 0.011 Å
• c: 23.557 ± 0.018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1950 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1133
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.0766
• Weighted residual factors for all reflections included in the refinement: 0.0902
• Goodness-of-fit parameter for all reflections included in the refinement: 0.797
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes